BDBM50073949 CHEMBL2063816

SMILES: CCOC(=O)C1=C(C)NC(C)=C(C1c1ccc(OC)c(OC)c1)C(=O)OCC

InChI Key: InChIKey=GIYFJYMMDKPPIX-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50073949   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
α-glucosidase (Saccharomyces cerevisiae S288c (Baker's yeast))	BDBM50073949 (CHEMBL2063816) Show SMILES CCOC(=O)C1=C(C)NC(C)=C(C1c1ccc(OC)c(OC)c1)C(=O)OCC |c:5,10| Show InChI InChI=1S/C21H27NO6/c1-7-27-20(23)17-12(3)22-13(4)18(21(24)28-8-2)19(17)14-9-10-15(25-5)16(11-14)26-6/h9-11,19,22H,7-8H2,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl alpha-D-glucopyranoside as substrate preincubated for 15 mins measured u...				Eur J Med Chem 95: 199-209 (2015) Article DOI: 10.1016/j.ejmech.2015.03.018 BindingDB Entry DOI: 10.7270/Q2K075Z5
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